N-(4-bromanyl-2-methyl-phenyl)-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-1-(5-cyano-2-pyridyl)piperidine-4-carboxamide CAS Name: N-(4-bromo-2-methylphenyl)-1-(5-cyano-2-pyridinyl)-4-piperidinecarboxamide IUPAC Name: N-(4-bromo-2-methylphenyl)-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-1-(5-cyano-2-pyridyl)isonipecotamide Formula: C19H19BrN4O MolecularWeight: 399.28436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C2CCN(CC2)C3=NC=C(C=C3)C#N

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C2CCN(CC2)C3=NC=C(C=C3)C#N

InChI

InChI=1S/C19H19BrN4O/c1-13-10-16(20)3-4-17(13)23-19(25)15-6-8-24(9-7-15)18-5-2-14(11-21)12-22-18/h2-5,10,12,15H,6-9H2,1H3,(H,23,25)